%chk=000126051.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126051

0 1
 S    3.403700     -0.1390000     -0.2001000    
 O    3.550500      -1.316600      -1.038900    
 O    3.815000       1.168400     -0.6830000    
 O   -1.224700      -1.903700     -0.6254000    
 O   -4.096800      -1.852300      0.1876000    
 O   -4.889900      0.1260000      0.7249000    
 N  -0.6283000      0.3674000     -0.4310000    
 N   -2.504600       1.313700      0.2450000    
 N   -3.938300     -0.6093000      0.3411000    
 C    1.718600     -3.3199999E-02  0.3136000    
 C   0.7655000      0.2338000     -0.8427000    
 C    4.277400     -0.4493000       1.317400    
 C   -1.246600       1.523400     -7.3799998E-02
 C   -1.527800     -0.6461000     -0.3404000    
 C    5.766400     -0.5745000       1.084500    
 C   -2.686200     -3.6800001E-02  8.1400000E-02
 C  -0.5540000       2.828000     -6.0100000E-02
 H    1.656400      0.7645000       1.060800    
 H    1.467100     -0.9788000      0.8056000    
 H    1.045400       1.157100      -1.362800    
 H   0.8278000     -0.5506000      -1.604900    
 H    4.064900      0.3815000       1.996700    
 H    3.878000      -1.373400       1.745400    
 H    6.284600     -0.7650000       2.029300    
 H    5.992400      -1.398700      0.4003000    
 H    6.177800      0.3421000      0.6496000    
 H   0.3406000       2.799600      0.5688000    
 H  -0.2670000       3.129600      -1.072200    
 H   -1.213900       3.604200      0.3413000    
 H  -0.2702000      -1.990000     -0.7771000    


%chk=000126051-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126051

0 1
S 3.362533 0.355038 -0.273968
O 3.026240 -0.743369 -1.483244
O 4.898153 0.866149 -0.116527
O 0.586098 -1.502378 -1.422807
O -0.728321 -3.235404 0.614261
O -2.596362 -2.285585 1.540302
N 0.039979 0.734998 -0.609885
N -1.554616 0.266124 0.936529
N -1.494093 -2.215678 0.874073
C 2.252710 1.914391 -0.706268
C 0.979409 1.490737 -1.447242
C 2.740434 -0.394886 1.446146
C -0.885244 1.256122 0.330789
C -0.070298 -0.680755 -0.579140
C 2.890579 -1.909213 1.436826
C -1.053483 -0.924298 0.400098
C -1.095060 2.719117 0.574133
H 2.939448 2.505220 -1.334522
H 2.076317 2.411083 0.260813
H 0.480554 2.405181 -1.817161
H 1.241474 0.878643 -2.329176
H 3.401206 0.136072 2.150679
H 1.695372 -0.054238 1.528401
H 2.567994 -2.284286 2.427115
H 2.246325 -2.391384 0.683579
H 3.935493 -2.222756 1.277613
H -0.189385 3.232823 0.949793
H -1.429866 3.250743 -0.337035
H -1.884264 2.821313 1.334349
H 1.604474 -1.277525 -1.527623


